N-[(6-methyl-4-oxidanylidene-chromen-3-yl)methyl]-N-(phenylmethyl)quinoline-8-sulfonamide

Systemtic Name: N-[(6-methyl-4-oxidanylidene-chromen-3-yl)methyl]-N-(phenylmethyl)quinoline-8-sulfonamide Openeye Name: N-benzyl-N-[(6-methyl-4-oxo-chromen-3-yl)methyl]quinoline-8-sulfonamide CAS Name: N-[(6-methyl-4-oxo-1-benzopyran-3-yl)methyl]-N-(phenylmethyl)-8-quinolinesulfonamide IUPAC Name: N-benzyl-N-[(6-methyl-4-oxochromen-3-yl)methyl]quinoline-8-sulfonamide Traditional Name: N-benzyl-N-[(4-keto-6-methyl-chromen-3-yl)methyl]quinoline-8-sulfonamide Formula: C27H22N2O4S MolecularWeight: 470.53958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC=C(C2=O)CN(CC3=CC=CC=C3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)OC=C(C2=O)CN(CC3=CC=CC=C3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C27H22N2O4S/c1-19-12-13-24-23(15-19)27(30)22(18-33-24)17-29(16-20-7-3-2-4-8-20)34(31,32)25-11-5-9-21-10-6-14-28-26(21)25/h2-15,18H,16-17H2,1H3